CCOc1ccccc1O[C@@H]1CCCN(c2ncc(C(=O)O)cc2F)C1
Nom: (R)-6-(3-(2-ethoxyphenoxy)piperidin-1-yl)-5-fluoronicotinic acid
SMILES: CCOc1ccccc1O[C@@H]1CCCN(c2ncc(C(=O)O)cc2F)C1

Molecular Processing

Molecular formula
C19H21FN2O4
Molecular weight
360.39
Exact mass
360.1485
XLogP
3.37
TPSA
71.89
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
94.63

Supplementary Information

Récupération des détails…

Impliqué dans 3 réactions